0 B13R1.3 COC1=CC=C(CNC(C)C)C=C1 P36504 [0,0,0,0,0,0|2,0,1]=3 1 B13R1.3 COC1=CC=C(OCC(C)N)C=C1 P35304 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.3 COC1=NC=C(CCC(=O)O)C=C1 Q60513 [0,0,0,0,0,0|3,0,0]=3 3 B13R1.3 COC1=NC=C(\C=C\C(=O)O)C=C1 Q60792 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.3 NCC1=CC=C(CCC(=O)O)C=C1 P37476 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.21 CC(=O)NCC1=CC=C(Br)C=C1 P35246 [1,0,0,0,0,0|2,0,0]=3 6 B12R1.21 CC(=O)NCC1=NC=C(N)C=C1 O29811 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.21 CC(=O)\C=C\C1=NC=C(C)C=C1 O32130 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 P36503 [1,0,0,0,0,0|2,0,1]=4 9 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 P39657 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.21 CC1=NC=C(CCC(=O)O)C=C1 Q60510 [1,0,0,0,0,0|3,0,0]=4 11 B12R1.21 NC(=O)CCC1=CC=C(Br)C=C1 P37285 [1,0,0,0,0,0|3,0,0]=4 12 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 P38386 [1,0,0,0,0,0|3,0,0]=4 13 B12R1.21 O=C(Cl)CCC1=CC=C(Br)C=C1 N24618 [1,0,0,0,0,0|3,0,0]=4 14 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 P38000 [1,0,0,0,0,0|3,0,0]=4 15 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 P40757 [1,0,0,0,0,0|3,0,0]=4 16 B12R1.71 C=CCOC1=CC=C(OC)C=C1 P41609 [1,0,0,0,0,0|2,0,1]=4 17 B12R1.71 CCOCC1=CC=C(C=O)C=C1 Q68273 [1,0,0,0,0,0|2,0,1]=4 18 B12R1.71 CCOCC1=CC=C(CO)C=C1 Q68755 [1,0,0,0,0,0|2,0,1]=4 19 B12R1.71 CNCCC1=CC=C(OC)C=C1 P38192 [1,0,0,0,0,0|2,0,0]=3 20 B12R1.71 COC1=CC=C(CCCBr)C=C1 O28114 [1,0,0,0,0,0|2,0,1]=4 21 B12R1.71 COC1=CC=C(CCCI)C=C1 O28095 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.71 COC1=CC=C(CCCN)C=C1 P38522 [1,0,0,0,0,0|2,0,1]=4 23 B12R1.71 COC1=CC=C(CCCO)C=C1 P37549 [1,0,0,0,0,0|1,0,2]=4 24 B12R1.71 COCOC1=CC=C(OC)C=C1 Q68165 [1,0,0,0,0,0|3,0,0]=4 25 B14R1.2 COC1=CC=C(C(=O)CC(C)=O)C=C1 P38254 [0,1,0,0,0,0|1,0,1]=3 26 B14R1.2 COC1=CC=C([C@@H](N)CC(=O)O)C=C1 O28976 [0,1,0,0,0,0|2,0,0]=3 27 B14R1.2 COC1=CC=C([C@H](N)CC(=O)O)C=C1 O28958 [0,1,0,0,0,0|2,0,0]=3 28 B14R1.3 CCC1=CC=C(CC(N)C(=O)O)C=C1 O28924 [0,1,0,0,0,0|3,0,0]=4 29 B14R1.3 CCC1=CC=C(C[C@@H](N)C(=O)O)C=C1 M22655 [0,1,0,0,0,0|3,0,0]=4 30 B14R1.3 CCC1=CC=C(C[C@H](N)C(=O)O)C=C1 O28819 [0,1,0,0,0,0|3,0,0]=4 31 B14R1.3 COC1=CC=C(CC(=O)C(=O)O)C=C1 O28768 [0,1,0,0,0,0|2,0,0]=3 32 B14R1.3 COC1=CC=C(C[C@H](N)C(=O)O)C=C1 P37010 [0,1,0,0,0,0|2,0,0]=3 33 B14R1.5 COC1=CC=C(CNC(=O)CCl)C=C1 P35940 [0,1,0,0,0,0|1,0,0]=2 34 B14R1.142 CCOC1=CC=C(CCC(=O)O)C=C1 P37894 [0,1,0,0,0,0|2,0,0]=3 35 B14R1.142 NCCC1=CC=C(CCC(=O)O)C=C1 P36039 [0,1,0,0,0,0|3,0,0]=4 36 B14R1.211 COC1=CC=C(CNC(C)(C)C)C=C1 P39540 [0,1,0,0,0,0|2,0,1]=4 37 B14R1.419 CC(=O)NCC1=CC=C(C(=O)O)C=C1 P42308 [0,1,0,0,0,0|3,0,0]=4 38 B14R1.419 CC(C)C1=CC=C(CCC(=O)O)C=C1 P37235 [0,1,0,0,0,0|3,0,0]=4 39 B14R1.419 CN(C)C1=CC=C(CCC(=O)O)C=C1 P36360 [0,1,0,0,0,0|3,0,0]=4 40 B14R1.3653 COC1=CC=C(CCC(=O)O)C=C1F O28425 [0,1,0,0,0,0|2,0,0]=3 41 B14R1.3653 COC1=CC=C(CCC(=O)O)C=C1O P42581 [0,1,0,0,0,0|2,0,0]=3 42 B14R1.3653 COC1=CC=C(\C=C\C(=O)O)C=C1Br Q53450 [0,1,0,0,0,0|2,0,1]=4 43 B14R2.27 COC1=CC=C(C2CC(=O)N2)C=C1 P40394 [0,0,0,1,0,0|1,0,0]=2 44 B14R2.134 COC1=CC2=C(C=C1)C=NC(C)=C2 Q65388 [0,0,0,1,0,0|2,0,1]=4 45 B14R2.328 COC1=CC=C(CNC2CC2)C=C1 P36506 [0,0,0,1,0,0|2,0,1]=4 46 B12R1.4 C#CC1=CC=C(CC(=O)O)C=C1 P39766 [0,0,0,0,1,0|2,0,1]=4 47 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 P39368 [0,0,0,0,1,0|3,0,0]=4 48 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 L19340 [0,0,0,0,1,0|2,0,0]=3 49 B12R1.4 COC1=CC=C(CC(=O)[O-])C=C1 Q66992 [0,0,0,0,1,0|1,0,0]=2 50 B12R1.4 COC1=CC=C(NC(C)C)C=C1 P40746 [0,0,0,0,1,0|2,0,1]=4 51 B12R1.4 COC1=CC=C(OC(C)=O)C=C1 Q67288 [0,0,0,0,1,0|0,0,0]=1 52 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 P42337 [0,0,0,0,1,0|3,0,0]=4 53 B14R1.4 CCC1=CC=C(OCCC(=O)O)C=C1 M23358 [0,0,0,0,0,1|3,0,0]=4 54 B14R1.4 COC1=CC=C(CCNC(C)C)C=C1 P35483 [0,0,0,0,0,1|2,0,1]=4 55 B14R1.4 COC1=CC=C(CNCC(=O)O)C=C1 P39864 [0,0,0,0,0,1|2,0,0]=3 56 B11R1.1 CCOCC1=CC=C(Br)C=C1 Q68272 [2,0,0,0,0,0|1,0,1]=4 57 B11R1.1 CNCCC1=CC=C(C)C=C1 P39523 [2,0,0,0,0,0|2,0,0]=4 58 B11R1.91 CC(=O)C#CC1=CC=CC=C1 P40366 [2,0,0,0,0,0|1,0,1]=4 59 B11R1.83 C=CCC1=CN=C(OC)C=C1 N26473 [2,0,0,0,0,0|1,0,1]=4 60 B11R1.83 CCC1=CC=C(CNC)C=C1 P37356 [2,0,0,0,0,0|2,0,0]=4 61 B11R1.83 CCCC1=CN=C(OC)C=C1 N26472 [2,0,0,0,0,0|1,0,1]=4 62 B11R1.83 CCNC1=CC=C(OC)C=C1 P42858 [2,0,0,0,0,0|1,0,1]=4 63 B11R1.83 CNCC1=CN=C(OC)C=C1 L19846 [2,0,0,0,0,0|2,0,0]=4 64 B11R1.83 COC1=CC=C(CCBr)C=C1 P41235 [2,0,0,0,0,0|1,0,1]=4 65 B11R1.83 COC1=CC=C(CNN)C=C1 C-3256 [2,0,0,0,0,0|2,0,0]=4 66 B11R1.83 COCC1=CC=C(C=O)C=C1 N25868 [2,0,0,0,0,0|2,0,0]=4 67 B11R1.83 COCC1=CC=C(CO)C=C1 M23214 [2,0,0,0,0,0|2,0,0]=4 68 B11R1.83 N#CC1=CC=C(CC=O)C=C1 K12007 [2,0,0,0,0,0|2,0,0]=4 69 B13R1.14 CNC(=O)CCC1=CC=C(N)C=C1 P36526 [1,1,0,0,0,0|2,0,0]=4 70 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 P36248 [1,1,0,0,0,0|2,0,0]=4 71 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 P39021 [1,1,0,0,0,0|2,0,0]=4 72 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 P38714 [1,1,0,0,0,0|2,0,0]=4 73 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 P35204 [1,1,0,0,0,0|2,0,0]=4 74 B13R1.132 CC(=O)CC(=O)C1=CC=C(C)C=C1 P38255 [1,1,0,0,0,0|1,0,1]=4 75 B13R1.132 CC1=CC=C([C@@H](N)CC(=O)O)C=C1 O28951 [1,1,0,0,0,0|2,0,0]=4 76 B13R1.132 CC1=CC=C([C@H](N)CC(=O)O)C=C1 O28914 [1,1,0,0,0,0|2,0,0]=4 77 B13R1.132 NC(CC(=O)O)C1=CC=C(O)C=C1 P37138 [1,1,0,0,0,0|2,0,0]=4 78 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(O)C=C1 O28469 [1,1,0,0,0,0|2,0,0]=4 79 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(O)C=C1 O28468 [1,1,0,0,0,0|2,0,0]=4 80 B13R1.132 O=C(O)CC(O)C1=CC=C(O)C=C1 M23080 [1,1,0,0,0,0|2,0,0]=4 81 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O 10746 [1,1,0,0,0,0|2,0,0]=4 82 B13R1.133 O=C(O)C(=O)CC1=CC=C(O)C=C1 P40943 [1,1,0,0,0,0|2,0,0]=4 83 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(O)C=C1 O32356 [1,1,0,0,0,0|2,0,0]=4 84 B13R1.164 CC(=O)CCC1=CC=C(Cl)C=C1F O29579 [1,1,0,0,0,0|2,0,0]=4 85 B13R1.164 CC1=CC=C(CCC(=O)O)C(Br)=C1 M23365 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.164 O=C(O)CCC1=CC=C(O)C=C1O P37397 [1,1,0,0,0,0|2,0,0]=4 87 B13R1.511 CC(=O)OCC1=CC(=O)C(O)=CO1 L18963 [1,1,0,0,0,0|1,0,0]=3 88 B13R1.511 CC1=CC=C(CCC(=O)O)C=C1C P39352 [1,1,0,0,0,0|2,0,0]=4 89 B13R1.511 O=C(O)CCC1=CC=C(O)C(O)=C1 P42738 [1,1,0,0,0,0|2,0,0]=4 90 B13R1.5 CCC(=O)CC1=CC=C(OC)C=C1 P37560 [1,1,0,0,0,0|1,0,1]=4 91 B13R1.371 CCCNCC1=CC=C(OC)C=C1 P35252 [1,1,0,0,0,0|1,0,1]=4 92 B13R1.371 CCNCCC1=CC=C(OC)C=C1 P36279 [1,1,0,0,0,0|1,0,1]=4 93 B13R1.371 CNCCCC1=CC=C(OC)C=C1 P35871 [1,1,0,0,0,0|1,0,1]=4 94 B13R1.371 COC1=CC=C(CCCCBr)C=C1 P38617 [1,1,0,0,0,0|1,0,1]=4 95 B13R1.371 COC1=CC=C(CCCCI)C=C1 M23184 [1,1,0,0,0,0|1,0,1]=4 96 B13R1.371 COC1=CC=C(CNCCO)C=C1 P36842 [1,1,0,0,0,0|1,0,1]=4 97 B13R1.371 COC1=CC=C(COCCBr)C=C1 O28416 [1,1,0,0,0,0|0,0,1]=3 98 B13R1.371 COC1=CC=C(COCCO)C=C1 P41449 [1,1,0,0,0,0|0,0,1]=3 99 B13R1.4 COC1=CC=C(CS(N)(=O)=O)C=C1 H-8154 [0,1,0,0,1,0|2,0,0]=4 100 B13R1.35 COC1=C(C)C=C(OC(C)C)C=C1 N26994 [0,1,0,0,1,0|1,0,1]=4 101 B13R1.35 COC1=CC=C(OC(C)=O)C=C1F N27075 [0,1,0,0,1,0|0,0,0]=2 102 B13R1.36 CCC1=CC=C(C(N)C(=O)O)C=C1 P38862 [0,1,0,0,1,0|2,0,0]=4 103 B13R1.36 COC1=CC=C(C(=O)C(=O)O)C=C1 P36487 [0,1,0,0,1,0|1,0,1]=4 104 B13R1.36 COC1=CC=C(C(N)C(=O)O)C=C1 G-5944 [0,1,0,0,1,0|1,0,0]=3 105 B13R1.36 COC1=CC=C(C(N)C(=O)O)C=C1 L13499 [0,1,0,0,1,0|1,0,0]=3 106 B13R1.36 COC1=CC=C([C@@H](N)C(=O)O)C=C1 P39404 [0,1,0,0,1,0|1,0,0]=3 107 B13R1.36 COC1=CC=C([C@@H](N)C(N)=O)C=C1 M22953 [0,1,0,0,1,0|1,0,0]=3 108 B13R1.36 COC1=CC=C([C@H](N)C(=O)O)C=C1 P39405 [0,1,0,0,1,0|1,0,0]=3 109 B13R1.142 CCOC1=CN=C(CC(=O)O)C=C1 Q60808 [0,1,0,0,1,0|2,0,0]=4 110 B13R1.142 CCOC1=NC=C(CC(=O)O)C=C1 Q60855 [0,1,0,0,1,0|2,0,0]=4 111 B13R1.142 NCCC1=CC=C(CC(=O)O)C=C1 P34751 [0,1,0,0,1,0|2,0,0]=4 112 B13R1.585 CC(=O)C1=CC=C(CC(=O)O)C=C1 O27998 [0,1,0,0,1,0|2,0,0]=4 113 B13R1.585 CC(=O)NC1=CC=C([C@@H](C)N)C=C1 P51603 [0,1,0,0,1,0|2,0,0]=4 114 B13R1.585 CN(C)C1=CC=C(CC(=O)O)C=C1 P40604 [0,1,0,0,1,0|2,0,0]=4 115 B13R1.653 COC1=CC(F)=C(CC(C)=O)C=C1 F-4362 [0,1,0,0,1,0|0,0,0]=2 116 B15R1.17 CCOC1=CC=C(OCCC(=O)O)C=C1 M23360 [0,1,0,0,0,1|2,0,0]=4 117 B15R1.204 COC1=CC=C(C[C@@H](N)CC(=O)O)C=C1 P40458 [0,1,0,0,0,1|2,0,0]=4 118 B15R1.204 COC1=CC=C(C[C@H](N)CC(=O)O)C=C1 P35538 [0,1,0,0,0,1|2,0,0]=4 119 B15R1.205 COC1=CC=C(CC[C@@H](N)C(=O)O)C=C1 P35920 [0,1,0,0,0,1|2,0,0]=4 120 B15R1.205 COC1=CC=C(CC[C@H](N)C(=O)O)C=C1 P35919 [0,1,0,0,0,1|2,0,0]=4 121 B15R1.206 COC(=O)CNCC1=CC=C(OC)C=C1 P39863 [0,1,0,0,0,1|1,0,0]=3 122 B15R1.206 COC1=CC=C(CCNC(=O)CCl)C=C1 P40484 [0,1,0,0,0,1|1,0,0]=3 123 B15R1.211 COC(=O)CC(N)C1=CC=C(OC)C=C1 M23011 [0,2,0,0,0,0|1,0,0]=3 124 B15R1.3 COC(=O)[C@@H](N)CC1=CC=C(OC)C=C1 P40547 [0,2,0,0,0,0|1,0,0]=3 125 B15R1.3 COC(=O)[C@H](N)CC1=CC=C(OC)C=C1 Q65830 [0,2,0,0,0,0|1,0,0]=3 126 B15R1.16 CCOC1=CC=C(CC(N)C(=O)O)C=C1 P36294 [0,2,0,0,0,0|2,0,0]=4 127 B15R1.16 CCOC1=CC=C(C[C@@H](N)C(=O)O)C=C1 P41843 [0,2,0,0,0,0|2,0,0]=4 128 B15R1.16 CCOC1=CC=C(C[C@H](N)C(=O)O)C=C1 P38799 [0,2,0,0,0,0|2,0,0]=4 129 B15R1.208 CN[C@@H](CC1=CC=C(OC)C=C1)C(=O)O P37613 [0,2,0,0,0,0|2,0,0]=4 130 B15R1.216 COC1=CC=C(CC(C)(C)C(=O)O)C=C1 P39025 [0,2,0,0,0,0|2,0,0]=4 131 B15R1.216 COC1=CC=C(CC(C)(N)C(=O)O)C=C1 Q65855 [0,2,0,0,0,0|2,0,0]=4 132 B15R1.216 COC1=CC=C(C[C@@](C)(N)C(=O)O)C=C1 Q65853 [0,2,0,0,0,0|2,0,0]=4 133 B15R1.216 COC1=CC=C(C[C@](C)(N)C(=O)O)C=C1 Q65854 [0,2,0,0,0,0|2,0,0]=4 134 B15R1.1855 COC1=CC(F)=C(C[C@@H](N)C(=O)O)C=C1 P41878 [0,2,0,0,0,0|2,0,0]=4 135 B15R1.1855 COC1=CC(F)=C(C[C@H](N)C(=O)O)C=C1 P41870 [0,2,0,0,0,0|2,0,0]=4 136 B15R1.3777 COC1=C(C)C=C(C[C@H](N)C(=O)O)C=C1 P36551 [0,2,0,0,0,0|2,0,0]=4 137 B15R1.3777 COC1=C(F)C=C(C[C@@H](N)C(=O)O)C=C1 P43082 [0,2,0,0,0,0|2,0,0]=4 138 B15R1.3777 COC1=C(F)C=C(C[C@H](N)C(=O)O)C=C1 P41866 [0,2,0,0,0,0|2,0,0]=4 139 B15R1.793 CCOC(=O)C#CC1=CC=C(OC)C=C1 P37696 [0,2,0,0,0,0|1,0,1]=4 140 B15R1.793 CCOC(=O)CNC1=CC=C(OC)C=C1 P37766 [0,2,0,0,0,0|2,0,0]=4 141 B15R1.3779 COC(=O)CCC1=CC=C(OC)C(O)=C1 P41800 [0,2,0,0,0,0|1,0,0]=3 142 B15R1.56 CCCOC1=CC=C(CCC(=O)O)C=C1 O27889 [0,2,0,0,0,0|2,0,0]=4 143 B13R2.147 CC1=CC=C(C2CC(=O)N2)C=C1 P39794 [1,0,0,1,0,0|1,0,0]=3 144 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)C1 P39325 [1,0,0,1,0,0|2,0,0]=4 145 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)N1 L20848 [1,0,0,1,0,0|2,0,0]=4 146 B13R2.147 O=C1CC(C2=CC=C(Cl)C=C2)N1 P39793 [1,0,0,1,0,0|2,0,0]=4 147 B13R2.147 O=C1CC(C2=CC=C(F)C=C2)N1 P35036 [1,0,0,1,0,0|2,0,0]=4 148 B13R2.155 O=C1CC2=C(C=CC(Br)=C2)CN1 Q70043 [1,0,0,1,0,0|2,0,0]=4 149 B13R2.155 O=C1CCC2=C(C=C(O)C=C2)C1 M15801 [1,0,0,1,0,0|1,0,0]=3 150 B13R2.57 COC1=CC2=C(C=C1)CCNC2 P43271 [1,0,0,1,0,0|2,0,0]=4 151 B13R2.669 CCC1=CC2=C(C=C1)CCC2=O P38134 [1,0,0,1,0,0|2,0,0]=4 152 B13R2.2121 COC1=CC=C2CC(=O)NC2=N1 Q55139 [0,0,0,1,1,0|2,0,0]=4 153 B13R2.2121 COC1=CC=C2NC(=O)CC2=N1 Q64310 [0,0,0,1,1,0|2,0,0]=4 154 B13R2.2121 COC1=CC=C2NC(=O)NC2=C1 P39867 [0,0,0,1,1,0|2,0,0]=4 155 B13R2.2121 COC1=CN=C2NC(=O)CC2=C1 Q55141 [0,0,0,1,1,0|2,0,0]=4 156 B13R2.2121 COC1=NC=C2NC(=O)CC2=C1 Q64412 [0,0,0,1,1,0|2,0,0]=4 157 B15R2.2 COC1=CC=C(C2CCC(=O)C2)C=C1 Q69545 [0,0,0,1,0,1|1,0,0]=3 158 B15R2.451 COC1=CC=C(C2CC2C(=O)O)C=C1 Q69955 [0,0,0,1,0,1|2,0,0]=4 159 B15R2.2880 COC1=CC=C2C=CNC(=O)CC2=C1 O33998 [0,0,0,1,0,1|1,0,1]=4 160 B15R2.7688 NC(=O)NCC1=CC2=C(C=C1)OCO2 L18965 [0,1,0,1,0,0|2,0,0]=4 161 B15R2.7688 O=C(O)CCC1=CC=C2OCCC2=C1 P39733 [0,1,0,1,0,0|2,0,0]=4 162 B15R2.7688 O=C(O)CCC1=CC=C2OCOC2=C1 P39078 [0,1,0,1,0,0|2,0,0]=4 163 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 M15214 [1,0,0,0,1,0|2,0,0]=4 164 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 P40160 [1,0,0,0,1,0|1,0,0]=3 165 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 P41430 [1,0,0,0,1,0|1,0,0]=3 166 B11R1.20 CC(C)OC1=CC=C(O)C=C1 O30893 [1,0,0,0,1,0|1,0,1]=4 167 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 O31092 [1,0,0,0,1,0|2,0,0]=4 168 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 O27991 [0,0,0,0,2,0|1,0,1]=4 169 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 L20737 [0,0,0,0,2,0|2,0,0]=4 170 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 P36753 [0,0,0,0,2,0|2,0,0]=4 171 B11R1.3 CCC1=CC=C(C(C)=O)C=N1 Q53712 [0,0,0,0,2,0|2,0,0]=4 172 B11R1.3 COC1=CN=C(C(=O)O)C=C1 Q68348 [0,0,0,0,2,0|2,0,0]=4 173 B13R1.513 O=C(O)CCCC1=CC=C(O)C=C1 P36541 [1,0,0,0,0,1|2,0,0]=4 174 B13R1.513 O=C(O)CNCC1=CC=C(O)C=C1 P39618 [1,0,0,0,0,1|2,0,0]=4 175 B13R1.643 COC1=CN=CC(CCC(=O)O)=C1 Q60511 [0,0,0,0,1,1|2,0,0]=4 176 B13R1.643 COC1=NC=CC(CCC(=O)O)=C1 Q60484 [0,0,0,0,1,1|2,0,0]=4